N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine
TL;DR: N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine (CAS 880812-74-8) is a chemical compound with molecular formula C13H20ClNO3 and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-2-methoxyethanamine
Also Known As: N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine, AN-465/42886071, N-(3-chloro-4-ethoxy-5-methoxybenzyl)-N-(2-methoxyethyl)amine, N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-2-methoxyethanamine, [(3-CHLORO-4-ETHOXY-5-METHOXYPHENYL)METHYL](2-METHOXYETHYL)AMINE
| Molecular Formula | C13H20ClNO3 |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 2.4833 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 273.11316 |
| Heavy Atoms | 18 |
| Complexity | 371.49915 |
Chemical Identifiers
| CAS Number | 880812-74-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1Cl)CNCCOC)OC |
Product Overview
N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine (CAS 880812-74-8), with molecular formula C13H20ClNO3 and molecular weight 273.11 g/mol. IUPAC: N-[(3-chloro-4-ethoxy-5-methoxyphenyl)methyl]-2-methoxyethanamine.
Chemical Property Profile of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine
Property Insights of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine
The XLogP value of 2.4833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine. With a topological polar surface area (TPSA) of 39.72 Ų, N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine?
The CAS number of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine is 880812-74-8.
What is the molecular formula of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine?
The molecular formula of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine is C13H20ClNO3.
What is the molecular weight of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine?
The molecular weight of N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine is 273.11 g/mol.
Where can I buy N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine?
You can request a quote for N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-ethoxy-5-methoxybenzyl)-2-methoxyethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.